Scopoletin
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Product Description
Product
Scopoletin
CAS
92-61-5
Formula
C10H8O4
Synonym
Scopoletin; 2H-1-Benzopyran-2-one, 7-hydroxy-6-methoxy-; 2H-1-Benzopyran-2-one, 7-hydroxy-6-methoxy- (9CI); 5-18-03-00203 (Beilstein Handbook Reference); 6-Methoxy-7-hydroxycoumarin; 6-Methylesculetin; 6-O-Methylesculetin; 7-Hydroxy-6-methoxy-2H-1-benzopyran-2-one; 7-Hydroxy-6-methoxycoumarin; beta-Methylesculetin; BRN 0156296; CCRIS 3592; Chrysatropic acid; Coumarin, 7-hydroxy-6-methoxy-; EINECS 202-171-9; Escopoletin; Esculetin 6-methyl ether; Gelseminic acid; Murrayetin; NSC 405647; Scopoletine; Scopoletol; UNII-KLF1HS0SXJ
Typical Product Specifications
Molecular weight
192.17
SMILES
c12c(cc(O)c(c1)OC)oc(=O)cc2
InChI
1S/C10H8O4/c1-13-9-4-6-2-3-10(12)14-8(6)5-7(9)11/h2-5,11H,1H3
InChIKey
RODXRVNMMDRFIK-UHFFFAOYSA-N
Melting Point
204 ° C
Atmospheric OH Rate Constant
4.02E-11 cm3/molecule-sec
log P (octanol-water)
0.860
Class
Scopoletin
Product Description
Product
Scopoletin
CAS
92-61-5
Formula
C10H8O4
Synonym
Scopoletin; 2H-1-Benzopyran-2-one, 7-hydroxy-6-methoxy-; 2H-1-Benzopyran-2-one, 7-hydroxy-6-methoxy- (9CI); 5-18-03-00203 (Beilstein Handbook Reference); 6-Methoxy-7-hydroxycoumarin; 6-Methylesculetin; 6-O-Methylesculetin; 7-Hydroxy-6-methoxy-2H-1-benzopyran-2-one; 7-Hydroxy-6-methoxycoumarin; beta-Methylesculetin; BRN 0156296; CCRIS 3592; Chrysatropic acid; Coumarin, 7-hydroxy-6-methoxy-; EINECS 202-171-9; Escopoletin; Esculetin 6-methyl ether; Gelseminic acid; Murrayetin; NSC 405647; Scopoletine; Scopoletol; UNII-KLF1HS0SXJ
Typical Product Specifications
Molecular weight
192.17
SMILES
c12c(cc(O)c(c1)OC)oc(=O)cc2
InChI
1S/C10H8O4/c1-13-9-4-6-2-3-10(12)14-8(6)5-7(9)11/h2-5,11H,1H3
InChIKey
RODXRVNMMDRFIK-UHFFFAOYSA-N
Melting Point
204 ° C
Atmospheric OH Rate Constant
4.02E-11 cm3/molecule-sec
log P (octanol-water)
0.860
Class
